3-(4-fluoro-2-pyridinyl)-5-methylpyridine

C11H9FN2 — CID 102824529

IUPAC3-(4-fluoro-2-pyridinyl)-5-methylpyridine
SMILESCc1cncc(-c2cc(F)ccn2)c1
InChIInChI=1S/C11H9FN2/c1-8-4-9(7-13-6-8)11-5-10(12)2-3-14-11/h2-7H,1H3
InChIKeyVBQQPWQVTYBZIF-UHFFFAOYSA-N
MW188.20 g/mol
LogP2.59
Rot. Bonds1

About 3-(4-fluoro-2-pyridinyl)-5-methylpyridine

3-(4-fluoro-2-pyridinyl)-5-methylpyridine (PubChem CID 102824529) has the molecular formula C11H9FN2 and a molecular weight of 188.20 g/mol. Its IUPAC name is 3-(4-fluoro-2-pyridinyl)-5-methylpyridine.

Molecular Properties

Compound Name3-(4-fluoro-2-pyridinyl)-5-methylpyridine
PubChem CID102824529
Molecular FormulaC11H9FN2
Molecular Weight188.20 g/mol
Exact Mass188.07
IUPAC Name3-(4-fluoro-2-pyridinyl)-5-methylpyridine
SMILESCc1cncc(-c2cc(F)ccn2)c1
InChIInChI=1S/C11H9FN2/c1-8-4-9(7-13-6-8)11-5-10(12)2-3-14-11/h2-7H,1H3
InChIKeyVBQQPWQVTYBZIF-UHFFFAOYSA-N
XLogP2.59
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.20
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluoro-2-pyridinyl)-5-methylpyridine?
The IUPAC name of 3-(4-fluoro-2-pyridinyl)-5-methylpyridine (CID 102824529) is 3-(4-fluoro-2-pyridinyl)-5-methylpyridine.
What is the SMILES notation for 3-(4-fluoro-2-pyridinyl)-5-methylpyridine?
The canonical SMILES for 3-(4-fluoro-2-pyridinyl)-5-methylpyridine is Cc1cncc(-c2cc(F)ccn2)c1.
What is the InChIKey of 3-(4-fluoro-2-pyridinyl)-5-methylpyridine?
The InChIKey is VBQQPWQVTYBZIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN2/c1-8-4-9(7-13-6-8)11-5-10(12)2-3-14-11/h2-7H,1H3.
What are the key properties of 3-(4-fluoro-2-pyridinyl)-5-methylpyridine?
3-(4-fluoro-2-pyridinyl)-5-methylpyridine has a molecular weight of 188.20 g/mol, XLogP of 2.59, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluoro-2-pyridinyl)-5-methylpyridine is sourced from PubChem (CID 102824529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).